5-chloranyl-1-(phenylmethyl)-3-propan-2-yl-pyrazole-4-carbaldehyde

Systemtic Name: 5-chloranyl-1-(phenylmethyl)-3-propan-2-yl-pyrazole-4-carbaldehyde Openeye Name: 1-benzyl-5-chloro-3-isopropyl-pyrazole-4-carbaldehyde CAS Name: 5-chloro-1-(phenylmethyl)-3-propan-2-yl-4-pyrazolecarboxaldehyde IUPAC Name: 1-benzyl-5-chloro-3-propan-2-ylpyrazole-4-carbaldehyde Traditional Name: 1-benzyl-5-chloro-3-isopropyl-pyrazole-4-carbaldehyde Formula: C14H15ClN2O MolecularWeight: 262.7347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=C1C=O)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=NN(C(=C1C=O)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C14H15ClN2O/c1-10(2)13-12(9-18)14(15)17(16-13)8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3